| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L058681
BDB058681
|
BDBM50515365
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1ccc(-c2ccccc2C(F)F)o1
|
C23H16F2N2O4 422.387000 |
JRMRWNYTQKOBHT-UNOMPAQXSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515365; PubChem:CID155559844
|
Local ready
Direct docking supported
|
|
E3L058682
BDB058682
|
BDBM50515366
CC1=NN(c2ccc(C#N)cc2)C(=O)/C1=C\c1ccc(-c2cc(C)c(C)cc2[N+](=O)[O-])o1
|
C24H18N4O4 426.432000 |
MQAQYZFPDYIZOW-NDENLUEZSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515366; PubChem:CID155539735
|
Local ready
Direct docking supported
|
|
E3L058683
BDB058683
|
BDBM50515367
CC1=NN(c2ccc(P(=O)(O)O)cc2)C(=O)/C1=C\c1ccc(-c2cc(C)c(C)cc2[N+](=O)[O-])o1
|
C23H20N3O7P 481.401000 |
ZQPADARKEGNUFA-UNOMPAQXSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515367; PubChem:CID155519829
|
Local ready
Direct docking supported
|
|
E3L058684
BDB058684
|
BDBM50515368
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1ccc(-c2cccc3c2C(=O)CC3)o1
|
C25H18N2O5 426.428000 |
WHYQTFFTGCKZHP-MOSHPQCFSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515368; PubChem:CID155537172
|
Local ready
Direct docking supported
|
|
E3L058685
BDB058685
|
BDBM50515369
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1cnc(-c2cc(C)c(C)cc2[N+](=O)[O-])s1
|
C23H18N4O5S 462.487000 |
UUNCMCGIQGVANK-ZDLGFXPLSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515369; PubChem:CID155521226
|
Local ready
Direct docking supported
|
|
E3L058686
BDB058686
|
BDBM50515370
Cc1cc(-c2ccc(/C=C3/SC(=O)N(c4ccc(C(=O)O)cc4)C3=O)o2)c([N+](=O)[O-])cc1C
|
C23H16N2O7S 464.455000 |
UACAOFPCDDPKNB-RGVLZGJSSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515370; PubChem:CID155543664
|
Local ready
Direct docking supported
|
|
E3L058687
BDB058687
|
BDBM50515371
CC1=NN(c2cc(F)c(O)c(F)c2)C(=O)/C1=C\c1ccc(-c2ccccc2C(F)F)o1
|
C22H14F4N2O3 430.357000 |
MSZYIGLMWSFOFV-YBEGLDIGSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515371; PubChem:CID155525448
|
Local ready
Direct docking supported
|
|
E3L058688
BDB058688
|
BDBM50515372
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C(/C)c1ccc(-c2cc(C)c(C)cc2[N+](=O)[O-])o1
|
C25H21N3O6 459.458000 |
DWPFUPITQDISNV-HAHDFKILSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50515372; PubChem:CID155548318
|
Local ready
Direct docking supported
|
|
E3L058689
BDB058689
|
BDBM50515373
CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@@H](NC(=O)CCCCCCCCCCC#Cc2cnc(OC[C@@H]3CCC(=O)N3)c3cc(OC)c(C(N)=O)cc23)C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C1CCCCC1
|
C56H76N8O8 989.272000 |
CVFKSFVSLDSCBQ-ROZMQCGGSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM50515373
|
Local ready
Direct docking supported
|
|
E3L058690
BDB058690
|
BDBM50515374
COc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(Br)c2cc1C(N)=O
|
C16H16BrN3O4 394.225000 |
IPUGCJLTEYLCFC-QMMMGPOBSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM50515374; PubChem:CID155548286
|
Local ready
Direct docking supported
|
|
E3L058691
BDB058691
|
BDBM50515375
COc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CCCCCCCCCCCC(=O)N[C@H](C(=O)N3C[C@H](O)C[C@H]3C(=O)NCc3ccc(-c4scnc4C)cc3)C(C)(C)C)c2cc1C(N)=O
|
C51H65N7O8S 936.189000 |
DFCKZXBDTTURLE-ABFWCBLXSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM50515375
|
Local ready
Direct docking supported
|
|
E3L058692
BDB058692
|
BDBM50515376
COc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CCCCCCCCCCCOc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)c2cc1C(N)=O
|
C41H45N5O9 751.837000 |
POTNHTDKTOIKCT-PAMMARIWSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM50515376; PubChem:CID155517957
|
Local ready
Direct docking supported
|
|
E3L058693
BDB058693
|
BDBM50515377
COc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CCOCCOCCOCCC(=O)N[C@H](C(=O)N3C[C@H](O)C[C@H]3C(=O)NCc3ccc(-c4scnc4C)cc3)C(C)(C)C)c2cc1C(N)=O
|
C48H59N7O11S 942.105000 |
HEUMLQGYGXEOHM-UPOJZSHJSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM50515377
|
Local ready
Direct docking supported
|
|
E3L058694
BDB058694
|
BDBM50515378
CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@@H](NC(=O)CCOCCOCCOCC#Cc2cnc(OC[C@@H]3CCC(=O)N3)c3cc(OC)c(C(N)=O)cc23)C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C1CCCCC1
|
C53H70N8O11 995.188000 |
OGZACTPFSVITBX-IHPDELBNSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM50515378
|
Local ready
Direct docking supported
|
|
E3L058695
BDB058695
|
BDBM50515602
CC(=O)N(Cc1ccc(OCc2ccc(F)cc2)cc1)C(C(=O)NC1CCCCC1)c1c(C(=O)O)[nH]c2cc(Cl)ccc12
|
C33H33ClFN3O5 606.094000 |
GCYOJGNHSQSNLB-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50515602; PubChem:CID155540935
|
Local ready
Direct docking supported
|
|
E3L058696
BDB058696
|
BDBM50515603
CC(C)(C)NC(=O)C(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)N(C=O)Cc1ccc(OCc2ccccc2Cl)cc1
|
C30H29Cl2N3O5 582.484000 |
LMXOUCGXEZTHRD-UHFFFAOYSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50515603; PubChem:CID155539551
|
Local ready
Direct docking supported
|
|
E3L058697
BDB058697
|
BDBM50515604
CC(C)(C)NC(=O)[C@H](c1c(C(=O)O)[nH]c2cc(Cl)ccc12)N(C=O)Cc1ccc(OCc2ccccc2Br)cc1
|
C30H29BrClN3O5 626.935000 |
ZYUXHGXGYZXKTO-MHZLTWQESA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM50515604; PubChem:CID155558699
|
Local ready
Direct docking supported
|
|
E3L058698
BDB058698
|
BDBM50515605
CC(C)(C)NC(=O)C(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)N(C=O)Cc1ccc(OCc2ccc3ccccc3c2)cc1
|
C34H32ClN3O5 598.099000 |
JVXSKAKDQZMULB-UHFFFAOYSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM50515605; PubChem:CID155550524
|
Local ready
Direct docking supported
|
|
E3L058699
BDB058699
|
BDBM50515606
O=CN(Cc1ccc(OCc2ccc(Br)cc2)cc1)C(C(=O)NC12CC3CC(CC(C3)C1)C2)c1c(C(=O)O)[nH]c2cc(Cl)ccc12
|
C36H35BrClN3O5 705.049000 |
UOKLKZYWYUNSQH-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50515606; PubChem:CID155513253
|
Local ready
Direct docking supported
|
|
E3L058700
BDB058700
|
BDBM50515607
CC(C)(C)NC(=O)C(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)N(C=O)Cc1ccc(OCc2cccc(F)c2)cc1
|
C30H29ClFN3O5 566.029000 |
GCPFJSDTDJIVFA-UHFFFAOYSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50515607; PubChem:CID155540256
|
Local ready
Direct docking supported
|